AG00AB85

18228-17-6 | Naphthol AS-E phosphate

AG00AB85

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CAS Number	18228-17-6
Catalog Number	AG00AB85(AGN-PC-0JLWUI)
Chemical Name	Naphthol AS-E phosphate
EC Number	242-106-1
IUPAC Name	[3-[(4-chlorophenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate
InChI	InChI=1S/C17H13ClNO5P/c18-13-5-7-14(8-6-13)19-17(20)15-9-11-3-1-2-4-12(11)10-16(15)24-25(21,22)23/h1-10H,(H,19,20)(H2,21,22,23)
InChI Key	RQAQWBFHPMSXKR-UHFFFAOYSA-N
MDL Number	MFCD00042718
Molecular Formula	C17H13ClNO5P
Molecular Weight	377.7156
NSC Number	746568
SMILES	O=C(C1=C(OP(O)(O)=O)C=C2C=CC=CC2=C1)NC3=CC=C(Cl)C=C3
Synonyms	KG 501, KG-501, KG501 cpd, naphthol AS-E phosphate, Naphthol AS-E phosphate, 18228-17-6, KG-501, Naphtholas-ephosphate, N-(4-Chlorophenyl)-3-(phosphonooxy)naphthalene-2-carboxamide, 3-[(4-chlorophenyl)carbamoyl]-2-naphthyl dihydrogen phosphate, [3-[(4-chlorophenyl)carbamoyl]naphthalen-2-yl] dihydrogen phosphate, EINECS 242-106-1, KG 501, NASEP, AC1L3DTC, AC1Q3SJF, SCHEMBL11979377, CTK8D6016, DTXSID10171275, BCP29194, EX-A2026, KG-501(Naphthol AS-E phosphate), ZINC2168663, MFCD00042718, NSC746568, AKOS024375425, API0003507, DB08240, MCULE-1291316751, Naphthol AS-E phosphate, for histology, NSC-746568, VZ33480, HY-103299, AK00305069, CS-0027313, FT-0712758, ST51016114, C-48084, N-(4-Chlorophenyl)-3-phosphonooxy-2-naphthalenecarboxamide, 2-Naphthalenecarboxamide,N-(4-chlorophenyl)-3-(phosphonooxy)-, 3-(4-chlorophenylcarbamoyl)naphthalen-2-yl dihydrogen phosphate, {3-[(4-chlorophenyl)carbamoyl]naphthalen-2-yl}oxyphosphonic acid, 3-[(4-chlorophenyl)carbamoyl]naphthalen-2-yl dihydrogen phosphate, 3-[N-(4-chlorophenyl)carbamoyl](2-naphthyl) dihydrogen phosphate, N-(4-Chlorophenyl)-3-(phosphonooxy)naphthalene-2-carboxamide / KG-501 / NASEP, N3P, Acetylmuramic acid, N-acetylmuramic acid, N-Acetylisomuramic acid, KG501 cpd, C17H13ClNO5P, NAPHTHOL AS-TR ACETATE, C11H19NO8, C17-H13-Cl-N-O5-P, CID87517, AR-1F0608, C11-H19-N-O8, C495860, 2-Acetamido-3-O-((S)-1-carboxyethyl)-2-deoxy-D-glucose, 1856-93-5,

Complexity	519
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	377.022g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	377.717g/mol
Monoisotopic Mass	377.022g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	95.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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